Update GHA and postBuild to install aids_tools.

materialdigital · Jan 29, 2025 · 98a4bbb · 98a4bbb
1 parent 32ddeec
commit 98a4bbb
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Showing 5 changed files with 9 additions and 4 deletions.
diff --git a/.github/workflows/aiida.yml b/.github/workflows/aiida.yml
@@ -9,7 +9,7 @@ jobs:
   build:
 
     runs-on: ubuntu-latest
-    
+
     steps:
     - uses: actions/checkout@v4
     - uses: conda-incubator/setup-miniconda@v3
@@ -22,6 +22,7 @@ jobs:
       shell: bash -l {0}
       run: |
         pip install -e aiida_qe_basic
+        pip install -e adis_tools
         conda install -c conda-forge jupyter papermill
         verdi presto
         export ESPRESSO_PSEUDO=$(pwd)/espresso/pseudo

diff --git a/.github/workflows/basic.yml b/.github/workflows/basic.yml
@@ -9,7 +9,7 @@ jobs:
   build:
 
     runs-on: ubuntu-latest
-    
+
     steps:
     - uses: actions/checkout@v4
     - uses: conda-incubator/setup-miniconda@v3
@@ -22,6 +22,7 @@ jobs:
       shell: bash -l {0}
       run: |
         pip install -e aiida_qe_basic
+        pip install -e adis_tools
         conda install -c conda-forge jupyter papermill
         export ESPRESSO_PSEUDO=$(pwd)/espresso/pseudo
         papermill basic.ipynb basic-out.ipynb -k "python3"
diff --git a/.github/workflows/jobflow.yml b/.github/workflows/jobflow.yml
@@ -9,7 +9,7 @@ jobs:
   build:
 
     runs-on: ubuntu-latest
-    
+
     steps:
     - uses: actions/checkout@v4
     - uses: conda-incubator/setup-miniconda@v3
@@ -22,6 +22,7 @@ jobs:
       shell: bash -l {0}
       run: |
         pip install -e aiida_qe_basic
+        pip install -e adis_tools
         conda install -c conda-forge jupyter papermill
         export ESPRESSO_PSEUDO=$(pwd)/espresso/pseudo
         papermill jobflow.ipynb jobflow-out.ipynb -k "python3"
diff --git a/.github/workflows/pyiron.yml b/.github/workflows/pyiron.yml
@@ -9,7 +9,7 @@ jobs:
   build:
 
     runs-on: ubuntu-latest
-    
+
     steps:
     - uses: actions/checkout@v4
     - uses: conda-incubator/setup-miniconda@v3
@@ -22,6 +22,7 @@ jobs:
       shell: bash -l {0}
       run: |
         pip install -e aiida_qe_basic
+        pip install -e adis_tools
         conda install -c conda-forge jupyter papermill
         export ESPRESSO_PSEUDO=$(pwd)/espresso/pseudo
         papermill pyiron_base.ipynb pyiron_base-out.ipynb -k "python3"
diff --git a/postBuild b/postBuild
@@ -1,2 +1,3 @@
 pip install -e aiida_qe_basic
+pip install -e adis_tools
 verdi presto